P508-0798 Screening compound: N-(2,5-dimethylphenyl)-3-[1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide

P508-0798 Screening compound: N-(2,5-dimethylphenyl)-3-[1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
P508-0798 Screening compound: N-(2,5-dimethylphenyl)-3-[1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P508-0798
N-(2,5-dimethylphenyl)-3-[1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

P508-0798

Molecular Formula

C19H15FN6O2 (C19 H15 FN6 O2)

Compound Name

N-(2,5-dimethylphenyl)-3-[1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

N-(25-dimethylphenyl)-3-[1-(4-fluorophenyl)-1H-123-triazol-4-yl]-124-oxadiazole-5-carboxamide

SMILES

Cc1cc(NC(c2nc(-c3cn(-c(cc4)ccc4F)nn3)no2)=O)c(C)cc1

InChI

InChI=1S/C19H15FN6O2/c1-11-3-4-12(2)15(9-11)21-18(27)19-22-17(24-28-19)16-10-26(25-23-16)14-7-5-13(20)6-8-14/h3-10H,1-2H3,(H,21,27)

InChI Key

LROJUZPGUGSCIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27577641

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.282

Distribution Coefficient, logD

3.282

Water Solubility, LogSw

-3.30

Polar Surface Area

80.674

Acid Dissociation Constant (pKa)

11.20

Base Dissociation Constant (pKb)

-2.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

P508-0798 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with P508-0798 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P508-0798?
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What is the minimum amount of P508-0798 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P508-0798
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P508-0798
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of P508-0798 available by request